(2R)-N-(2-chloroethyl)-2-[[(2R)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-2-phenyl-ethanoyl]amino]-3-methyl-butanamide

Systemtic Name: (2R)-N-(2-chloroethyl)-2-[[(2R)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-2-phenyl-ethanoyl]amino]-3-methyl-butanamide Openeye Name: (2R)-N-(2-chloroethyl)-2-[[(2R)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-2-phenyl-acetyl]amino]-3-methyl-butanamide CAS Name: (2R)-N-(2-chloroethyl)-2-[[(2R)-2-[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]-1-oxo-2-phenylethyl]amino]-3-methylbutanamide IUPAC Name: (2R)-N-(2-chloroethyl)-2-[[(2R)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-2-phenylacetyl]amino]-3-methylbutanamide Traditional Name: (2R)-N-(2-chloroethyl)-2-[[(2R)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-2-phenyl-acetyl]amino]-3-methyl-butyramide Formula: C18H25Cl2N5O4 MolecularWeight: 446.3282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCCl)NC(=O)C(C1=CC=CC=C1)NC(=O)N(CCCl)N=O

Isomeric SMILES

CC(C)[C@H](C(=O)NCCCl)NC(=O)[C@@H](C1=CC=CC=C1)NC(=O)N(CCCl)N=O

InChI

InChI=1S/C18H25Cl2N5O4/c1-12(2)14(16(26)21-10-8-19)22-17(27)15(13-6-4-3-5-7-13)23-18(28)25(24-29)11-9-20/h3-7,12,14-15H,8-11H2,1-2H3,(H,21,26)(H,22,27)(H,23,28)/t14-,15-/m1/s1